SCHEMBL7464191

SCHEMBL7464191

Cc1c(Cc2c(F)cccc2F)ccc2[nH]c(C=O)nc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.36
ADAMTS5 Q9UNA0 3/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
LMNA P02545 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.32
GRIN2B Q13224 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
AR P10275 1/20 0.31
PKM P14618 1/20 0.30
NPC1 O15118 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PARP1 P09874 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7465037 0.82 MPO (0.39) MPOMGAMGAASIMGAM2
SCHEMBL7469303 0.80 MGAM (0.43) MPOMGAMGAASIMGAM2
SCHEMBL7160954 0.79 MPO (0.36) MPOMGAMGAASIMGAM2
SCHEMBL7461514 0.79 MPO (0.36) MPOMGAMGAASIMGAM2
SCHEMBL23782300 0.78 HRH4 (0.46) ADAMTS5MGAMGAASIMGAM2
SCHEMBL7469387 0.76 MGAM (0.53) MGAMGAASIMGAM2GRIN2B
SCHEMBL2767156 0.75 EGLN1 (0.42) ADAMTS5MGAMGAASIMGAM2
SCHEMBL7469947 0.74 MGAM (0.49) MPOMGAMGAASIMGAM2
Hydrochloric Acid SCHEMBL25221123 0.73 EGLN1 (0.41) ADAMTS5MGAMGAASIMGAM2
SCHEMBL7472604 0.73 KDM4E (0.49) MGAMGAASIMGAM2GRIN2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1210336-A1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE THE UNITED STATES OF AMERICA, as represented by the Secretary of the Department of Health and Human Services (US) 2002-06-05 EP disclosed
WO-2001014343-A1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-03-01 WO disclosed
EP-0963371-A1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1999-12-15 EP disclosed
WO-1998037072-A1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-08-27 WO disclosed